{"id":"W4380872654","doi":"10.1021/jacs.3c03512","title":"Teraryl Braces in Macrocycles: Synthesis and Conformational Landscape Remodeling of Peptides","year":2023,"lang":"en","type":"article","venue":"Journal of the American Chemical Society","topic":"Chemical Synthesis and Analysis","field":"Biochemistry, Genetics and Molecular Biology","cited_by":46,"is_retracted":false,"has_abstract":true,"ca_institutions":"University of Toronto","funders":"Higher Education Discipline Innovation Project; Nankai University; National Natural Science Foundation of China","keywords":"Chemistry; Heteroatom; Aryl; Side chain; Cyclic peptide; Peptide; Combinatorial chemistry; Stereochemistry; Organic chemistry; Biochemistry; Ring (chemistry)","routes":{"ca_aff":true,"ca_fund":false,"ca_venue":false,"about_ca":false,"invisible_to_affiliation_only":false},"retraction":null,"screen":null,"direct_labels":[],"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0001987316,0.00007248126,0.0002257752,0.00001856097,0.0000253967,0.00001030219,0.0001816978,0.00004077614,0.000007090289],"category_scores_gemma":[0.0002039899,0.0000474502,0.0002836984,0.0002107734,0.0001696872,0.000006189956,0.0001089228,0.00009917495,4.334273e-7],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00001056349,"about_ca_system_score_gemma":0.00002631801,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00001046665,"about_ca_topic_score_gemma":8.947501e-7,"domain_scores_codex":[0.9993137,0.00002202425,0.0003077778,0.00008498884,0.0001603022,0.000111166],"domain_scores_gemma":[0.9993913,0.0001012296,0.0003238916,0.00009307244,0.00005048373,0.00003998968],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"bench_or_experimental","study_design_gemma":"bench_or_experimental","study_design_scores_codex":[0.00002865268,0.00001838285,0.01484537,0.00001544916,0.00006591828,2.241264e-7,0.00008433494,0.00009124405,0.9796557,0.000001512382,0.001087971,0.004105181],"study_design_scores_gemma":[0.0001712693,0.00001804138,0.009454702,0.00006345419,0.00003233045,0.00001526054,0.0007248315,0.001937364,0.9867815,0.0001077379,0.0006068601,0.00008664011],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9989808,0.0001746323,0.00002511104,0.0007246971,0.00000933801,0.00001775843,0.000009608743,0.000001952336,0.00005616267],"genre_scores_gemma":[0.9982323,0.0007220329,0.0007744372,0.0001604419,0.00008546413,0.000001053833,0.000002198319,0.000005900656,0.00001619056],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.007125754,"threshold_uncertainty_score":0.1934963,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.00695365776102429,"score_gpt":0.2387021346853616,"score_spread":0.2317484769243373,"validation_status":"score_only:v0-immature-baseline","note":"Baseline scores from an immature model (maturity gate not passed). Scores rank; they never assert a category."}}